SCHEMBL7167119

SCHEMBL7167119

C=CCOc1ccc(OCc2ccccc2)c(CN2CCN(C(Cc3ccc(C#N)c(F)c3)c3cnc[nH]3)CC2=O)c1

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32
FNTA P49354 2/20 0.31
FNTB P49356 2/20 0.31
PGGT1B P53609 2/20 0.31
DPP4 P27487 1/20 0.31
RIPK3 Q9Y572 1/20 0.31
MAOB P27338 1/20 0.31
S1PR5 Q9H228 1/20 0.30
RET P07949 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7161945 0.89 PRMT5 (0.32) PRMT5WDR77DPP4
SCHEMBL6418028 0.81 PRMT5 (0.32) PRMT5WDR77FNTAFNTBPGGT1B
SCHEMBL6471063 0.79 FNTA (0.53) FNTAFNTBPGGT1B
SCHEMBL7166984 0.78 PRMT5 (0.41) PRMT5WDR77DPP4RIPK3RET
SCHEMBL7166236 0.77 FNTA (0.37) FNTAFNTBPGGT1BMAOB
SCHEMBL7167619 0.77 PRMT5 (0.31) PRMT5WDR77
SCHEMBL6448742 0.75 FNTA (0.37) FNTAFNTBPGGT1B
SCHEMBL6411179 0.74 PRMT5 (0.35) PRMT5WDR77RET
Hydrochloric Acid SCHEMBL6469829 0.73 FNTA (0.38) FNTAFNTBPGGT1B
SCHEMBL7165181 0.72 FNTA (0.37) FNTAFNTBPGGT1BMAOB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6562823-B1 Inhibition of farnesyl-protein transferase has been shown to block the growth of Ras-transformed cells in soft agar MERCK & CO., INC. 2003-05-13 US disclosed